| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 2nd, 2008 | 21 | Yes |
Popular Name: 2-[2-(4-isopropylphenyl)-2-oxo-ethyl]sulfanyl-6-methyl-1H-pyrimidin-4-one 2-[2-(4-isopropylphenyl)-2-oxo-e…
| Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
|---|---|---|---|---|---|---|---|---|---|---|
| Ref Reference (pH 7) | 4.03 | 7.99 | -11.88 | 1 | 4 | 0 | 63 | 302.399 | 5 | ↓ |
| Hi High (pH 8-9.5) | 4.49 | 6 | -45.81 | 0 | 4 | -1 | 66 | 301.391 | 5 | ↓ |
| Mid Mid (pH 6-8) | 4.03 | 7.38 | -17.4 | 1 | 4 | 0 | 63 | 302.399 | 5 | ↓ |
